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Inhibitor Report for: CHEMBL3792924

General
Type Trifluoro, Sulfur Compound, Thiomorpholine
Chemical_Nomenclature 4-[[4-[4-chloro-3-(trifluoromethyl)phenoxy]-3,5-difluorophenyl]methoxy]-6-(1,1-dioxo-1,4-thiazinan-4-yl)-1-methylpyrimidin-2-one
Canonical SMILES CN1C(=CC(=NC1=O)OCC2=CC(=C(C(=C2)F)OC3=CC(=C(C=C3)Cl)C(F)(F)F)F)N4CCS(=O)(=O)CC4
InChI InChI=1S/C23H19ClF5N3O5S/c1-31-20(32-4-6-38(34,35)7-5-32)11-19(30-22(31)33)36-12-13-8-17(25)21(18(26)9-13)37-14-2-3-16(24)15(10-14)23(27,28)29/h2-3,8-11H,4-7,12H2,1H3
InChIKey FLCSHCSBIFPQJJ-UHFFFAOYSA-N
Other name(s) SCHEMBL17884258 ; BDBM50162136 ; VQ7
________________________________________________________________________________________________
MW|579.92
Formula|C23H19ClF5N3O5S
CAS_number|
PubChem|121005813
UniChem|FLCSHCSBIFPQJJ-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | CHEMBL3792924 ligand of proteins in family: PAF-Acetylhydrolase
Stucture | 1 structure: 5I8P: Crystal structure of LP_PLA2 in complex with novel inhibitor
Protein | human-PLA2G7

References:
Search PubMed for references concerning: CHEMBL3792924
    Title: Structural and Thermodynamic Characterization of Protein-Ligand Interactions Formed between Lipoprotein-Associated Phospholipase A2 and Inhibitors
    Liu Q, Chen X, Chen W, Yuan X, Su H, Shen J, Xu Y
    Ref: Journal of Medicinal Chemistry, 59:5115, 2016 : PubMed